| SpectraBase Spectrum ID |
HFKJcWocUZb |
| Name |
Butanoic acid, 2-nitro-4-(phenylthio)-, 2,6-bis(1,1-dimethylethyl)-4-methoxyphenyl ester |
| CAS Registry Number |
113719-11-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H33NO5S |
| InChI |
InChI=1S/C25H33NO5S/c1-24(2,3)19-15-17(30-7)16-20(25(4,5)6)22(19)31-23(27)21(26(28)29)13-14-32-18-11-9-8-10-12-18/h8-12,15-16,21H,13-14H2,1-7H3 |
| InChIKey |
NFTWPJZKOYWWHX-UHFFFAOYSA-N |
| Molecular Weight |
459.601 g/mol |
| SMILES |
CC(c1cc(cc(c1OC(C(CCSc1ccccc1)N(=O)=O)=O)C(C)(C)C)OC)(C)C |
| SPLASH |
splash10-014i-9110000000-d342ef95629d52f5a38d |
| Source of Spectrum |
H-70-1512-13 |
| Synonyms |
2,6-Ditert-butyl-4-methoxyphenyl 2-nitro-4-(phenylsulfanyl)butanoate
2-Nitro-4-(phenylthio)butanoic acid (2,6-ditert-butyl-4-methoxyphenyl) ester
2-Nitro-4-(phenylthio)butyric acid (2,6-ditert-butyl-4-methoxy-phenyl) ester
(2,6-ditert-butyl-4-methoxyphenyl) 2-nitro-4-phenylsulfanylbutanoate |
| Wiley ID |
1390221 |
